[5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol

C12H15NO3 — CID 115711896

IUPAC[5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol
SMILESCC(NCc1ccc(CO)o1)c1ccoc1
InChIInChI=1S/C12H15NO3/c1-9(10-4-5-15-8-10)13-6-11-2-3-12(7-14)16-11/h2-5,8-9,13-14H,6-7H2,1H3
InChIKeyRLZSIONYZPTKDJ-UHFFFAOYSA-N
MW221.26 g/mol
LogP2.22
Rot. Bonds5

About [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol

[5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol (PubChem CID 115711896) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol
PubChem CID115711896
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name[5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol
SMILESCC(NCc1ccc(CO)o1)c1ccoc1
InChIInChI=1S/C12H15NO3/c1-9(10-4-5-15-8-10)13-6-11-2-3-12(7-14)16-11/h2-5,8-9,13-14H,6-7H2,1H3
InChIKeyRLZSIONYZPTKDJ-UHFFFAOYSA-N
XLogP2.22
TPSA58.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-[[[(1R)-1-phenylethyl]amino]methyl]furan-2-yl]methanol
CID 79032632
[5-[[[(1S)-1-(3-methylphenyl)ethyl]amino]methyl]furan-2-yl]methanol
CID 81364609
[5-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]methyl]furan-2-yl]methanol
CID 64579003
[5-[[[(2S)-1-methoxypropan-2-yl]amino]methyl]furan-2-yl]methanol
CID 96569409
3-[[5-(hydroxymethyl)furan-2-yl]methylamino]-2-methylbutan-1-ol
CID 111467126
[5-[[1-(2-bromophenyl)ethylamino]methyl]furan-2-yl]methanol
CID 64579765
N-[1-(furan-3-yl)ethyl]-2-methylprop-2-en-1-amine
CID 104579893
N-[(2,5-dimethyl-1,3-thiazol-4-yl)methyl]-1-(furan-3-yl)ethanamine
CID 115896778
2-[[5-(hydroxymethyl)furan-2-yl]methylamino]-3-methylbutanamide
CID 103699286
5-[1-(furan-3-yl)ethylamino]-4,4-dimethylpentan-1-ol
CID 103898963
[5-[(1-methylsulfonylpropan-2-ylamino)methyl]furan-2-yl]methanol
CID 64631010
1-[1-(furan-3-yl)ethylamino]-3-methylpentan-2-ol
CID 115719585

Frequently Asked Questions

What is the IUPAC name of [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol?
The IUPAC name of [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol (CID 115711896) is [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol is CC(NCc1ccc(CO)o1)c1ccoc1.
What is the InChIKey of [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol?
The InChIKey is RLZSIONYZPTKDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-9(10-4-5-15-8-10)13-6-11-2-3-12(7-14)16-11/h2-5,8-9,13-14H,6-7H2,1H3.
What are the key properties of [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol?
[5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol has a molecular weight of 221.26 g/mol, XLogP of 2.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[1-(furan-3-yl)ethylamino]methyl]furan-2-yl]methanol is sourced from PubChem (CID 115711896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).